(5-aminopyrimidin-2-yl)methanol;hydrochloride

C5H8ClN3O — CID 146035781

IUPAC(5-aminopyrimidin-2-yl)methanol;hydrochloride
SMILESCl.Nc1cnc(CO)nc1
InChIInChI=1S/C5H7N3O.ClH/c6-4-1-7-5(3-9)8-2-4;/h1-2,9H,3,6H2;1H
InChIKeyZOOWUTIOCRDHLD-UHFFFAOYSA-N
MW161.59 g/mol
LogP-0.03
Rot. Bonds1

About (5-aminopyrimidin-2-yl)methanol;hydrochloride

(5-aminopyrimidin-2-yl)methanol;hydrochloride (PubChem CID 146035781) has the molecular formula C5H8ClN3O and a molecular weight of 161.59 g/mol. Its IUPAC name is (5-aminopyrimidin-2-yl)methanol;hydrochloride.

Molecular Properties

Compound Name(5-aminopyrimidin-2-yl)methanol;hydrochloride
PubChem CID146035781
Molecular FormulaC5H8ClN3O
Molecular Weight161.59 g/mol
Exact Mass161.04
IUPAC Name(5-aminopyrimidin-2-yl)methanol;hydrochloride
SMILESCl.Nc1cnc(CO)nc1
InChIInChI=1S/C5H7N3O.ClH/c6-4-1-7-5(3-9)8-2-4;/h1-2,9H,3,6H2;1H
InChIKeyZOOWUTIOCRDHLD-UHFFFAOYSA-N
XLogP-0.03
TPSA72.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.59
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (5-aminopyrimidin-2-yl)methanol;hydrochloride?
The IUPAC name of (5-aminopyrimidin-2-yl)methanol;hydrochloride (CID 146035781) is (5-aminopyrimidin-2-yl)methanol;hydrochloride.
What is the SMILES notation for (5-aminopyrimidin-2-yl)methanol;hydrochloride?
The canonical SMILES for (5-aminopyrimidin-2-yl)methanol;hydrochloride is Cl.Nc1cnc(CO)nc1.
What is the InChIKey of (5-aminopyrimidin-2-yl)methanol;hydrochloride?
The InChIKey is ZOOWUTIOCRDHLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3O.ClH/c6-4-1-7-5(3-9)8-2-4;/h1-2,9H,3,6H2;1H.
What are the key properties of (5-aminopyrimidin-2-yl)methanol;hydrochloride?
(5-aminopyrimidin-2-yl)methanol;hydrochloride has a molecular weight of 161.59 g/mol, XLogP of -0.03, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-aminopyrimidin-2-yl)methanol;hydrochloride is sourced from PubChem (CID 146035781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).